tert-butyl (4R,6S,7R)-7-azanyl-4-oxidanyl-8-oxidanylidene-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: tert-butyl (4R,6S,7R)-7-azanyl-4-oxidanyl-8-oxidanylidene-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: tert-butyl (4R,6S,7R)-7-amino-4-hydroxy-8-oxo-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: (4R,6S,7R)-7-amino-4-hydroxy-8-oxo-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl (4R,6S,7R)-7-amino-4-hydroxy-8-oxo-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: (4R,6S,7R)-7-amino-4-hydroxy-8-keto-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid tert-butyl ester Formula: C12H18N2O4 MolecularWeight: 254.28232

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=CC(CC2N1C(=O)C2N)O

Isomeric SMILES

CC(C)(C)OC(=O)C1=C[C@@H](C[C@@H]2N1C(=O)[C@@H]2N)O

InChI

InChI=1S/C12H18N2O4/c1-12(2,3)18-11(17)8-5-6(15)4-7-9(13)10(16)14(7)8/h5-7,9,15H,4,13H2,1-3H3/t6-,7+,9-/m1/s1